6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide

C18H19Cl2N3O2 — CID 95532245

IUPAC6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)nc1
InChIInChI=1S/C18H19Cl2N3O2/c1-22(2)18(24)13-4-6-17(21-10-13)23-7-8-25-16(11-23)12-3-5-14(19)15(20)9-12/h3-6,9-10,16H,7-8,11H2,1-2H3/t16-/m1/s1
InChIKeyKXRVHSVBAGSXSG-MRXNPFEDSA-N
MW380.28 g/mol
LogP3.67
Rot. Bonds3

About 6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide

6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide (PubChem CID 95532245) has the molecular formula C18H19Cl2N3O2 and a molecular weight of 380.28 g/mol. Its IUPAC name is 6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide
PubChem CID95532245
Molecular FormulaC18H19Cl2N3O2
Molecular Weight380.28 g/mol
Exact Mass379.09
IUPAC Name6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)nc1
InChIInChI=1S/C18H19Cl2N3O2/c1-22(2)18(24)13-4-6-17(21-10-13)23-7-8-25-16(11-23)12-3-5-14(19)15(20)9-12/h3-6,9-10,16H,7-8,11H2,1-2H3/t16-/m1/s1
InChIKeyKXRVHSVBAGSXSG-MRXNPFEDSA-N
XLogP3.67
TPSA45.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.28
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-N-ethyl-N-methylpyridine-3-carboxamide
CID 95558310
6-[4-(2-amino-6-methylpyrimidin-4-yl)morpholin-2-yl]-N,N-dimethylpyridine-3-carboxamide
CID 110271991
[6-[2-(4-chlorophenyl)morpholin-4-yl]-3-pyridinyl]-piperidin-1-ylmethanone
CID 56868455
[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-(2-methylpyrimidin-5-yl)methanone
CID 95228845
(2R)-2-(3,4-dichlorophenyl)-4-(6-methoxypyrimidin-4-yl)morpholine
CID 95551468
(2R)-2-(3,4-dichlorophenyl)-4-(6-morpholin-4-ylpyrimidin-4-yl)morpholine
CID 95551993
N-ethyl-6-[(2R)-2-(6-methoxynaphthalen-2-yl)morpholin-4-yl]pyridine-3-carboxamide
CID 95558757
4-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-6-methylpyrimidin-2-amine
CID 95175522
2-(3,4-dichlorophenyl)-4-(5-methoxypyrimidin-2-yl)morpholine
CID 56868196
[6-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-3-pyridinyl]-morpholin-4-ylmethanone
CID 95561255
6-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-N,N-dimethylpyridine-3-carboxamide
CID 112627949
ethyl 6-[(3R,4R)-4-[(4-chlorobenzoyl)-methylamino]-3-(3,4-dichlorophenyl)piperidin-1-yl]pyridine-3-carboxylate
CID 68935710

Frequently Asked Questions

What is the IUPAC name of 6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide?
The IUPAC name of 6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide (CID 95532245) is 6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide?
The canonical SMILES for 6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide is CN(C)C(=O)c1ccc(N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)nc1.
What is the InChIKey of 6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide?
The InChIKey is KXRVHSVBAGSXSG-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H19Cl2N3O2/c1-22(2)18(24)13-4-6-17(21-10-13)23-7-8-25-16(11-23)12-3-5-14(19)15(20)9-12/h3-6,9-10,16H,7-8,11H2,1-2H3/t16-/m1/s1.
What are the key properties of 6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide?
6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide has a molecular weight of 380.28 g/mol, XLogP of 3.67, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-N,N-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 95532245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).